methyl 2-[[4-[[4-azanyl-5-[2,6-bis(fluoranyl)phenyl]carbonyl-1,3-thiazol-2-yl]amino]phenyl]carbonyl-methyl-amino]ethanoate

Systemtic Name: methyl 2-[[4-[[4-azanyl-5-[2,6-bis(fluoranyl)phenyl]carbonyl-1,3-thiazol-2-yl]amino]phenyl]carbonyl-methyl-amino]ethanoate Openeye Name: methyl 2-[[4-[[4-amino-5-(2,6-difluorobenzoyl)thiazol-2-yl]amino]benzoyl]-methyl-amino]acetate CAS Name: 2-[[[4-[[4-amino-5-[(2,6-difluorophenyl)-oxomethyl]-2-thiazolyl]amino]phenyl]-oxomethyl]-methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-[[4-amino-5-(2,6-difluorobenzoyl)-1,3-thiazol-2-yl]amino]benzoyl]-methylamino]acetate Traditional Name: 2-[[4-[[4-amino-5-(2,6-difluorobenzoyl)thiazol-2-yl]amino]benzoyl]-methyl-amino]acetic acid methyl ester Formula: C21H18F2N4O4S MolecularWeight: 460.453826

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC)C(=O)C1=CC=C(C=C1)NC2=NC(=C(S2)C(=O)C3=C(C=CC=C3F)F)N

Isomeric SMILES

CN(CC(=O)OC)C(=O)C1=CC=C(C=C1)NC2=NC(=C(S2)C(=O)C3=C(C=CC=C3F)F)N

InChI

InChI=1S/C21H18F2N4O4S/c1-27(10-15(28)31-2)20(30)11-6-8-12(9-7-11)25-21-26-19(24)18(32-21)17(29)16-13(22)4-3-5-14(16)23/h3-9H,10,24H2,1-2H3,(H,25,26)